Vitas-M small molecule compound

N-(biphenyl-2-yl)-2-{[4-(4-bromophenyl)-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide

Catalog ID
STK008595
SMILES Brc1ccc(cc1)n1c(SCC(=O)Nc2ccccc2c2ccccc2)nnc1c1cccnc1

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C27H20BrN5OS MW 542.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H20BrN5OS/c28-21-12-14-22(15-13-21)33-26(20-9-6-16-29-17-20)31-32-27(33)35-18-25(34)30-24-11-5-4-10-23(24)19-7-2-1-3-8-19/h1-17H,18H2,(H,30,34)
InChIKey
MXDGHJOAZCDBOH-UHFFFAOYSA-N
Synonyms
477330-93-1
2((4(4BROMOPHENYL)5(PYRIDIN3YL)4H124TRIAZOL3YL)SULFANYL)N(2PHENYLPHENYL)ACETAMIDE
2((4(4BROMOPHENYL)5PYRIDIN3YL124TRIAZOL3YL)SULFANYL)N(2PHENYLPHENYL)ACETAMIDE
477330931
Brc1ccc(cc1)n1c(SCC(=O)Nc2ccccc2c2ccccc2)nnc1c1cccnc1
C1=CC=C(C=C1)C2=CC=CC=C2NC(=O)CSC3=NN=C(N3C4=CC=C(C=C4)Br)C5=CN=CC=C5
InChI=1SC27H20BrN5OSc2821121422(151321)3326(209616291720)313227(33)351825(34)302411541023(24)197213819h117H18H2(H3034)
MFCD03224974
N((11BIPHENYL)2YL)2((4(4BROMOPHENYL)5(PYRIDIN3YL)4H124TRIAZOL3YL)THIO)ACETAMIDE
N(BIPHENYL2YL)2((4(4BROMOPHENYL)5(PYRIDIN3YL)4H124TRIAZOL3YL)SULFANYL)ACETAMIDE
STK008595
ZINC000001804779
ZINC01804779
ZINC1804779

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.